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Benzyl (2S)-2-tert-Butoxycarbonylamino-5-oxo-5-(2'-furyl)pentanoate
SpectraBase Compound ID 7jrnErrLDB
InChI InChI=1S/C21H25NO6/c1-21(2,3)28-20(25)22-16(11-12-17(23)18-10-7-13-26-18)19(24)27-14-15-8-5-4-6-9-15/h4-10,13,16H,11-12,14H2,1-3H3,(H,22,25)/t16-/m0/s1
InChIKey KPSHDEFVICESGA-INIZCTEOSA-N
Mol Weight 387.43 g/mol
Molecular Formula C21H25NO6
Exact Mass 387.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbX1FRBcFWI
Name Benzyl (2S)-2-tert-Butoxycarbonylamino-5-oxo-5-(2'-furyl)pentanoate
Alternate Name(s) benzyl (2S)-2-[(tert-butoxycarbonyl)amino]-5-(2-furyl)-5-oxopentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO6
InChI InChI=1S/C21H25NO6/c1-21(2,3)28-20(25)22-16(11-12-17(23)18-10-7-13-26-18)19(24)27-14-15-8-5-4-6-9-15/h4-10,13,16H,11-12,14H2,1-3H3,(H,22,25)/t16-/m0/s1
InChIKey KPSHDEFVICESGA-INIZCTEOSA-N
Molecular Weight 387.432 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(OCc1ccccc1)=O)(CCC(c1occc1)=O)[H]
SPLASH splash10-0udi-0093000000-20e0502e959e46fbd702
Source of Spectrum KC-0-1907-11
Wiley ID 825708